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Information card for entry 7705773
Preview
| Coordinates | 7705773.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H22 As Br2 Cl4 N3 Ni O |
|---|---|
| Calculated formula | C20 H22 As Br2 Cl4 N3 Ni O |
| SMILES | [As]1(=[O][Ni](Br)(Br)[n]2c1cccc2C)(c1nc(ccc1)C)c1nc(ccc1)C.C(Cl)Cl.C(Cl)Cl |
| Title of publication | Coordination chemistry of the bench-stable tris-2-pyridyl pnictogen ligands [E(6-Me-2-py)<sub>3</sub>] (E = As, As[double bond, length as m-dash]O, Sb). |
| Authors of publication | Plajer, Alex J.; Crusius, Daniel; Jethwa, Rajesh B.; García-Romero, Álvaro; Bond, Andrew D.; García-Rodríguez, Raúl; Wright, Dominic S. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 7 |
| Pages of publication | 2393 - 2402 |
| a | 12.5295 ± 0.0004 Å |
| b | 14.4095 ± 0.0005 Å |
| c | 15.1592 ± 0.0005 Å |
| α | 90° |
| β | 96.375 ± 0.002° |
| γ | 90° |
| Cell volume | 2719.98 ± 0.16 Å3 |
| Cell temperature | 180 ± 2 K |
| Ambient diffraction temperature | 180 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0707 |
| Residual factor for significantly intense reflections | 0.0536 |
| Weighted residual factors for significantly intense reflections | 0.1419 |
| Weighted residual factors for all reflections included in the refinement | 0.153 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 262662 (current) | 2021-03-05 | cif/ Updating files of 7705770, 7705771, 7705772, 7705773, 7705774, 7705775, 7705776, 7705777, 7705778, 7705779, 7705780, 7705781, 7705782 Original log message: Adding full bibliography for 7705770--7705782.cif. |
7705773.cif |
| 259396 | 2020-12-01 | cif/ Adding structures of 7705770, 7705771, 7705772, 7705773, 7705774, 7705775, 7705776, 7705777, 7705778, 7705779, 7705780, 7705781, 7705782 via cif-deposit CGI script. |
7705773.cif |
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Users of the data should acknowledge the original authors of the
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